(S)-Limonene
Properties
- Molecular formula
- C10H16
- Molar mass
- 136.24 g/mol
- Exact mass
- 136.1252 Da
- Density
- 0.8402 g/mL (at 20 °C)
- Melting point
- −90 °C
- Boiling point
- 176 °C
- logP
- 3.31Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 1
- Stereocentres
- Sin SMILES atom order
Identifiers
CAS number
5989-54-8SMILES
C=C(C)[C@@H]1CC=C(C)CC1InChIKey
XMGQYMWWDOXHJM-SNVBAGLBSA-NInChI
InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
16 names · show all
- Cyclohexene, 1-methyl-4-(1-methylethenyl)-, (4S)-
- p-Mentha-1,8-diene, (S)-(-)-
- Cyclohexene, 1-methyl-4-(1-methylethenyl)-, (S)-
- (4S)-1-Methyl-4-(1-methylethenyl)cyclohexene
- l-Limonene
- (-)-Limonene
- (-)-(S)-Limonene
- β-Limonene
- (S)-(-)-Limonene
- (-)-α-Limonene
- (S)-4-Isopropenyl-1-methyl-1-cyclohexene
- (4S)-Limonene
- (-)-(4S)-Limonene
- l-Carvene
- (S)-1-Methyl-4-(prop-1-en-2-yl)cyclohex-1-ene
- (4S)-1-Methyl-4-(prop-1-en-2-yl)cyclohex-1-ene
Work with (S)-Limonene
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
(+)-Limonene5989-27-5100 % similar
Limonene7705-14-8100 % similar
Perillaldehyde18031-40-859 % similar
(-)-Perillyl alcohol18457-55-159 % similar
Perillaldehyde2111-75-359 % similar
Perillyl alcohol536-59-459 % similar
Perillartine30950-27-754 % similar
Perillic acid7694-45-354 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds